EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

eugenyl isovalerate
(2-methoxy-4-prop-2-enylphenyl) 3-methylbutanoate

Supplier Sponsors

CAS Number: 61114-24-7Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:262-613-1
FDA UNII:FBC808249X
Nikkaji Web:J268.400D
XlogP3:3.60 (est)
Molecular Weight:248.32200000
Formula:C15 H20 O3
NMR Predictor:Predict (works with chrome or firefox)
Category:flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
JECFA Food Flavoring:1532 eugenyl isovalerate
FLAVIS Number:09.878 (Old)
DG SANTE Food Flavourings:09.878 eugenyl isovalerate
FEMA Number:4118 eugenyl isovalerate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):61114-24-7 ; EUGENYL ISOVALERATE
 
Physical Properties:
Appearance:white solid (est)
Assay: 99.00 to 100.00
Food Chemicals Codex Listed: No
Melting Point: 85.00 °C. @ 760.00 mm Hg
Boiling Point: 221.00 to 223.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.000469 mmHg @ 25.00 °C. (est)
Flash Point: 263.00 °F. TCC ( 128.33 °C. )
logP (o/w): 4.082 (est)
Soluble in:
 alcohol
 water, 3.727 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items:note
allyl valerate
allyl isovalerate
amyl valerate
amyl isovalerate
isoamyl valerate
isoamyl isovalerate
para-anisyl isovalerate
para-anisyl valerate
benzyl valerate
benzyl isovalerate
bornyl valerate
bornyl isovalerate
(-)-bornyl isovalerate
isobornyl isovalerate
S-sec-butyl thioisovalerate
butyl valerate
butyl isovalerate
isobutyl valerate
isobutyl isovalerate
carvyl isovalerate
cinnamyl valerate
cinnamyl isovalerate
citronellyl valerate
citronellyl isovalerate
para-cresyl valerate
para-cresyl isovalerate
cyclohexyl valerate
cyclohexyl isovalerate
cyclotene isovalerate
decyl valerate
decyl isovalerate
ethyl valerate
ethyl isovalerate
furfuryl isovalerate
furfuryl valerate
geranyl valerate
geranyl isovalerate
(E)-2-hepten-1-yl isovalerate
heptyl isovalerate
sec-heptyl isovalerate
heptyl valerate
(E)-2-hexen-1-yl valerate
(E)-2-hexen-1-yl isovalerate
(Z)-3-hexen-1-yl valerate
(Z)-3-hexen-1-yl isovalerate
hexyl valerate
hexyl isovalerate
linalyl valerate
linalyl isovalerate
menthyl valerate
menthyl isovalerate
methyl 2-methyl valerate
methyl 4-methyl valerate
2-methyl butyl isovalerate
4-methyl pentyl isovalerate
methyl thio isovalerate
methyl valerate
methyl isovalerate
myrtenyl isovalerate
neryl isovalerate
nonyl isovalerate
nonyl valerate
octyl valerate
octyl isovalerate
phenethyl isovalerate
2-phenethyl valerate
3-phenyl propyl isovalerate
phenyl propyl valerate
S-prenyl thioisovalerate
isopropyl thioisovalerate
propyl valerate
propyl isovalerate
isopropyl valerate
isopropyl isovalerate
rhodinyl isovalerate
terpinyl isovalerate
terpinyl valerate
 
Organoleptic Properties:
Odor Type: spicy
fruity spicy clove
Odor Description:at 100.00 %. fruity spicy clove
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Axsyn
For experimental / research use only.
Butanoic acid,3-methyl-, 2-methoxy-4-(2-propen-1-yl)phenyl ester
Parchem
eugenyl isovalerate
Penta International
EUGENYL ISOVALERATE
 
Safety Information:
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for eugenyl isovalerate usage levels up to:
  3.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.37 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.50 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI): 2300 (μg/person/day)
Threshold of Concern:1800 (μg/person/day)
Structure Class: I
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 22
 average usual ppmaverage maximum ppm
baked goods: 0.200001.00000
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: 0.200001.00000
cheese: 0.500002.50000
chewing gum: 1.000005.00000
condiments / relishes: 0.300001.50000
confectionery froastings: 0.200001.00000
egg products: --
fats / oils: 0.200001.00000
fish products: 0.200001.00000
frozen dairy: 0.500002.50000
fruit ices: 0.500002.50000
gelatins / puddings: --
granulated sugar: --
gravies: 0.300001.50000
hard candy: 1.000005.00000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: 0.200001.00000
milk products: 0.500002.50000
nut products: --
other grains: 0.200001.00000
poultry: 0.200001.00000
processed fruits: 0.400002.00000
processed vegetables: 0.400002.00000
reconstituted vegetables: 0.400002.00000
seasonings / flavors: 0.300001.50000
snack foods: 2.0000010.00000
soft candy: 1.000005.00000
soups: 0.300001.50000
sugar substitutes: --
sweet sauces: --
 
Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i).
Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm.
 average usage mg/kgmaximum usage mg/kg
Dairy products, excluding products of category 02.0 (01.0): 7.0000035.00000
Fats and oils, and fat emulsions (type water-in-oil) (02.0): 5.0000025.00000
Edible ices, including sherbet and sorbet (03.0): 10.0000050.00000
Processed fruit (04.1): 7.0000035.00000
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): --
Confectionery (05.0): 10.0000050.00000
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 5.0000025.00000
Bakery wares (07.0): 10.0000050.00000
Meat and meat products, including poultry and game (08.0): 2.0000010.00000
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): 2.0000010.00000
Eggs and egg products (10.0): --
Sweeteners, including honey (11.0): --
Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 5.0000025.00000
Foodstuffs intended for particular nutritional uses (13.0): 10.0000050.00000
Non-alcoholic ("soft") beverages, excl. dairy products (14.1): --
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 10.0000050.00000
Ready-to-eat savouries (15.0): 20.00000100.00000
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 5.0000025.00000
 
Safety References:
European Food Safety Athority(efsa):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...

European Food Safety Authority (EFSA) reference(s):

Flavouring Group Evaluation 60 (FGE.60): Consideration of eugenol and related hydroxyallylbenzene derivatives evaluated by JECFA (65th meeting) structurally related to ring- substituted phenolic substances evaluated by EFSA in FGE.22 (2006)
View page or View pdf

EPI System: View
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :3085213
National Institute of Allergy and Infectious Diseases:Data
(2-methoxy-4-prop-2-enylphenyl) 3-methylbutanoate
Chemidplus:0061114247
 
References:
 (2-methoxy-4-prop-2-enylphenyl) 3-methylbutanoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):3085213
Pubchem (sid):135233291
Pherobase:View
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
FDA Substances Added to Food (formerly EAFUS):View
KEGG (GenomeNet):C05119
HMDB (The Human Metabolome Database):HMDB34123
FooDB:FDB012394
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
anisic
ethyl para-anisate
FL/FR
3-
pentyl bicyclo[3.2.1]-6-octen-2-one
FR
balsamic
butyl cinnamate
FL/FR
ethyl cinnamate
FL/FR
tolu balsam oil
FL/FR
tolu balsam oil replacer
FR
caramellic
5-
ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-one
FL/FR
cheesy
2-
heptanone
FL/FR
coconut
tetrahydrojasmone
FR
earthy
pinus sylvestris leaf absolute
FL/FR
floral
benzyl formate
FL/FR
cherry blossom fragrance
FR
pink
frangipani absolute
FR
2-
hexylidene cyclopentanone
FL/FR
rhodinyl isobutyrate
FL/FR
rose carboxylate
FR
souroubea specialty
FR
ylang ylang flower oil III
FL/FR
fruity
para-
anisyl methyl ketone
FL/FR
apple cider fragrance
FR
baked
apple fragrance
FR
candy
apple fragrance
FR
1,4-
diethyl-6,8-dioxabicyclo(3.2.1)octane
FR
myrtle oil replacer
FR
strawberry furanone butyrate
FL/FR
xanthoxylum fruit oil
FR
green
octanal diethyl acetal
FL/FR
thuja occidentalis leaf absolute
FR
herbal
wild
carrot seed oil CO2 extract
FL/FR
dimethyl benzyl carbinyl crotonate
FL/FR
lavender absolute bulgaria
FL/FR
lavender absolute france
FL/FR
myrtle oil
FL/FR
myrtle oil morocco
FL/FR
nonisyl acetate
FR
honey
methyl phenyl acetate
FL/FR
spicy
alpha-
amyl cinnamyl alcohol
FL/FR
apple cinnamon fragrance
FR
bubble gum fragrance
FR
cinnamyl propionate
FL/FR
clove bud oil
FL/FR
2,5-
dimethyl bicyclo(3.2.1)-2-octen-3-yl acetate + 1,4-dimethyl bicyclo(3.2.1)-2-octen-3-yl acetate
FR
(E)-
propyl 2-furan acrylate
FL/FR
woody
beta-
caryophyllene alcohol acetate
FL/FR
kaempferia galanga rhizome oil
FL/FR
spicy pentanone
FL/FR
symroxane (Symrise)
FR
vetiver oil fractions
FR
For Flavor
No flavor group found for these
benzyl methyl tiglate
FL
butyl cinnamate
FL/FR
beta-
caryophyllene alcohol acetate
FL/FR
dimethyl benzyl carbinyl crotonate
FL/FR
5-
ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-one
FL/FR
2-
hexylidene cyclopentanone
FL/FR
myrtle oil morocco
FL/FR
pinus sylvestris leaf absolute
FL/FR
hexyl 3-mercaptobutanoate
FL
anise
anise
ethyl para-anisate
FL/FR
balsamic
ethyl cinnamate
FL/FR
tolu balsam oil
FL/FR
camphoreous
kaempferia galanga rhizome oil
FL/FR
caramellic
5-
ethyl-3,4,5,6-tetramethyl cyclohexen-2-one
FL
cheesy
2-
heptanone
FL/FR
creamy
2,4-
heptadienal
FL
fatty
2,4-
undecadienal
FL
floral
cinnamyl propionate
FL/FR
methyl phenyl acetate
FL/FR
rhodinyl isobutyrate
FL/FR
ylang ylang flower oil III
FL/FR
fruity
benzyl formate
FL/FR
(E)-
propyl 2-furan acrylate
FL/FR
spicy pentanone
FL/FR
strawberry furanone butyrate
FL/FR
green
octanal diethyl acetal
FL/FR
herbal
wild
carrot seed oil CO2 extract
FL/FR
lavender absolute bulgaria
FL/FR
lavender absolute france
FL/FR
spicy
alpha-
amyl cinnamyl alcohol
FL/FR
para-
anisyl methyl ketone
FL/FR
clove bud oil
FL/FR
myrtle oil
FL/FR
 
Potential Uses:
FRclove
FRspice
 
Occurrence (nature, food, other):note
 valerian root oil @ 0.1-0.4%
Data GC Search Trop Picture
 
Synonyms:
4-allyl-2-methoxyphenyl 3-methyl butanoate
4-allyl-2-methoxyphenyl 3-methylbutanoate
4-allyl-2-methoxyphenyl 3-methylbutyrate
4-allyl-2-methoxyphenyl isovalerate
 butanoic acid, 3-methyl-, 2-methoxy-4-(2-propen-1-yl)phenyl ester
 eugenol isovalerate
2-methoxy-4-(2-propen-1-yl)phenyl 3-methylbutanoate
(2-methoxy-4-prop-2-enylphenyl) 3-methylbutanoate
 
 
Notes:
Used as a food additive [EAFUS]
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